(phenylmethyl) N-[2-[3-bromanyl-1-(3,4-dimethoxyphenyl)-4-oxidanylidene-cyclohexyl]ethyl]-N-methyl-carbamate

Systemtic Name: (phenylmethyl) N-[2-[3-bromanyl-1-(3,4-dimethoxyphenyl)-4-oxidanylidene-cyclohexyl]ethyl]-N-methyl-carbamate Openeye Name: benzyl N-[2-[3-bromo-1-(3,4-dimethoxyphenyl)-4-oxo-cyclohexyl]ethyl]-N-methyl-carbamate CAS Name: N-[2-[3-bromo-1-(3,4-dimethoxyphenyl)-4-oxocyclohexyl]ethyl]-N-methylcarbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-[3-bromo-1-(3,4-dimethoxyphenyl)-4-oxocyclohexyl]ethyl]-N-methylcarbamate Traditional Name: N-[2-[3-bromo-1-(3,4-dimethoxyphenyl)-4-keto-cyclohexyl]ethyl]-N-methyl-carbamic acid benzyl ester Formula: C25H30BrNO5 MolecularWeight: 504.4134

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1(CCC(=O)C(C1)Br)C2=CC(=C(C=C2)OC)OC)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CN(CCC1(CCC(=O)C(C1)Br)C2=CC(=C(C=C2)OC)OC)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H30BrNO5/c1-27(24(29)32-17-18-7-5-4-6-8-18)14-13-25(12-11-21(28)20(26)16-25)19-9-10-22(30-2)23(15-19)31-3/h4-10,15,20H,11-14,16-17H2,1-3H3